SCHEMBL14474198

SCHEMBL14474198

CCOc1cc(-c2ccc(F)cc2)cc2c(NC)nc(-c3ccccn3)nc12

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ S1PR1 P21453 1/20 0.46
▸ CHRNA7 P36544 1/20 0.43
▸ MAPK14 Q16539 2/20 0.43
▸ FFAR1 O14842 6/20 0.42
▸ GRM5 P41594 3/20 0.41
▸ METAP2 P50579 1/20 0.41
▸ METAP1 P53582 1/20 0.41
▸ LMNA P02545 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ HTT P42858 1/20 0.41
▸ SMN1; SMN2 Q16637 1/20 0.41
▸ ABCB1 P08183 2/20 0.39
▸ ABCG2 Q9UNQ0 2/20 0.39
▸ CBFB Q13951 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16185164 0.94 GRM5 (0.43) S1PR1MAPK14FFAR1GRM5METAP2
SCHEMBL16185134 0.91 FFAR1 (0.47) S1PR1MAPK14FFAR1GRM5METAP2
SCHEMBL14474182 0.90 ABCB1 (0.47) MAPK14FFAR1GRM5METAP2METAP1
SCHEMBL14474192 0.89 CHRNA7 (0.43) S1PR1CHRNA7GRM5LMNAKDM4E
SCHEMBL16185147 0.89 FFAR1 (0.43) S1PR1CHRNA7MAPK14FFAR1GRM5
SCHEMBL16185154 0.89 GRM5 (0.42) S1PR1CHRNA7MAPK14FFAR1GRM5
SCHEMBL14475260 0.88 GRM5 (0.42) S1PR1MAPK14FFAR1GRM5METAP2
SCHEMBL16185141 0.88 CHRNA7 (0.42) S1PR1CHRNA7GRM5LMNAKDM4E
SCHEMBL16185142 0.87 CHRNA7 (0.42) S1PR1CHRNA7LMNASMN1; SMN2
SCHEMBL14474202 0.87 CHRNA7 (0.45) CHRNA7MAPK14GRM5LMNA

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — US disclosed
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-10-23 — — US disclosed
WO-2013003586-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-03 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20140315886-A1 QUINAZOLINES AS THERAPEUTIC COMPOUNDS AND RELATED METHODS OF USE PPP2CA, PPP4C, PPP3CB S1PR1 3969/4885CHRNA7 349/4885MAPK14 2173/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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